2,4,6-Trichloro-5-nitropyrimidine
TL;DR: 2,4,6-Trichloro-5-nitropyrimidine (CAS 4359-87-9) is a chemical compound with molecular formula C4Cl3N3O2 and molecular weight 226.91 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,6-trichloro-5-nitropyrimidine
Also Known As: 2,4,6-trichloro-5-nitropyrimidine, C4Cl3N3O2, 2,4,6-trichloro-5-nitro-pyrimidine, 2,4,6-trichloronitropyrimidine, PYRIMIDINE, 2,4,6-TRICHLORO-5-NITRO-
| Molecular Formula | C4Cl3N3O2 |
|---|---|
| Molecular Weight | 226.91 g/mol |
| LogP | 2.345 |
| Topological Polar Surface Area | 68.92 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 226.90561 |
| Heavy Atoms | 12 |
| Complexity | 319.31512 |
Chemical Identifiers
| CAS Number | 4359-87-9 |
|---|---|
| SMILES | C1(=C(N=C(N=C1Cl)Cl)Cl)[N+](=O)[O-] |
Product Overview
2,4,6-Trichloro-5-nitropyrimidine (CAS 4359-87-9), with molecular formula C4Cl3N3O2 and molecular weight 226.91 g/mol. IUPAC: 2,4,6-trichloro-5-nitropyrimidine.
Chemical Property Profile of 2,4,6-Trichloro-5-nitropyrimidine
Property Insights of 2,4,6-Trichloro-5-nitropyrimidine
The XLogP value of 2.345 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,4,6-Trichloro-5-nitropyrimidine. The TPSA of 68.92 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,4,6-Trichloro-5-nitropyrimidine. Following Lipinski's Rule of Five, 2,4,6-Trichloro-5-nitropyrimidine has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,4,6-Trichloro-5-nitropyrimidine?
The CAS number of 2,4,6-Trichloro-5-nitropyrimidine is 4359-87-9.
What is the molecular formula of 2,4,6-Trichloro-5-nitropyrimidine?
The molecular formula of 2,4,6-Trichloro-5-nitropyrimidine is C4Cl3N3O2.
What is the molecular weight of 2,4,6-Trichloro-5-nitropyrimidine?
The molecular weight of 2,4,6-Trichloro-5-nitropyrimidine is 226.91 g/mol.
Where can I buy 2,4,6-Trichloro-5-nitropyrimidine?
You can request a quote for 2,4,6-Trichloro-5-nitropyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4,6-Trichloro-5-nitropyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 2,4,6-Trichloro-5-nitropyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.